SCHEMBL19259952

SCHEMBL19259952

CS(=O)(=O)c1cc(-c2ccc(C(F)(F)F)cc2)cc(S(=O)(=O)c2cnc(CNC(=O)O)s2)c1

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 20/20 0.72
MAOA P21397 3/20 0.57
AOC3 Q16853 3/20 0.57
MAOB P27338 2/20 0.57
KCNH2 Q12809 2/20 0.57
LOXL3 P58215 2/20 0.56

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19259594 0.89 LOXL2 (0.71) LOXL2MAOAAOC3MAOBKCNH2
SCHEMBL19259932 0.89 LOXL2 (0.72) LOXL2MAOAAOC3MAOBKCNH2
SCHEMBL28641865 0.88 LOXL2 (0.67) LOXL2MAOAAOC3MAOBKCNH2
SCHEMBL29971073 0.88 LOXL2 (0.67) LOXL2MAOAAOC3MAOBKCNH2
SCHEMBL19274862 0.84 LOXL2 (1.00) LOXL2MAOAAOC3MAOBKCNH2
Hydrochloric Acid SCHEMBL19259760 0.83 LOXL2 (1.00) LOXL2MAOAAOC3MAOBKCNH2
SCHEMBL29971568 0.80 LOXL2 (0.63) LOXL2MAOAAOC3MAOBKCNH2
SCHEMBL19259647 0.79 LOXL2 (0.74) LOXL2MAOAAOC3KCNH2LOXL3
SCHEMBL29971329 0.79 LOXL2 (0.64) LOXL2MAOAAOC3MAOBKCNH2
SCHEMBL19259856 0.74 LOXL2 (0.77) LOXL2MAOAAOC3MAOBKCNH2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3416956-A1 METHYLAMINE DERIVATIVES AS LYSYSL OXIDASE INHIBITORS FOR THE TREATMENT OF CANCER The Institute of Cancer Research : The Royal Cancer Hospital (GB) 2018-12-26 EP disclosed
WO-2017141049-A1 METHYLAMINE DERIVATIVES AS LYSYSL OXIDASE INHIBITORS FOR THE TREATMENT OF CANCER THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2017-08-24 WO disclosed